ethyl (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methylidene-1H-isochromen-3-yl]ethanoate

Systemtic Name: ethyl (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methylidene-1H-isochromen-3-yl]ethanoate Openeye Name: ethyl (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methyleneisochroman-3-yl]acetate CAS Name: (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methylene-3,4-dihydro-1H-2-benzopyran-3-yl]acetic acid ethyl ester IUPAC Name: ethyl (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methylidene-1H-isochromen-3-yl]acetate Traditional Name: (2R)-2-[[(R)-tert-butylsulfinyl]amino]-2-[(3S)-4-methyleneisochroman-3-yl]acetic acid ethyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C(=C)C2=CC=CC=C2CO1)NS(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H]1C(=C)C2=CC=CC=C2CO1)N[S@](=O)C(C)(C)C

InChI

InChI=1S/C18H25NO4S/c1-6-22-17(20)15(19-24(21)18(3,4)5)16-12(2)14-10-8-7-9-13(14)11-23-16/h7-10,15-16,19H,2,6,11H2,1,3-5H3/t15-,16+,24-/m1/s1